4RI7
Crystal structure of poplar glutathione transferase F1 mutant SER 13 CYS
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM30A |
| Synchrotron site | ESRF |
| Beamline | BM30A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-02-15 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.979690 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 55.299, 60.649, 119.900 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 40.863 - 1.798 |
| R-factor | 0.1528 |
| Rwork | 0.150 |
| R-free | 0.19510 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4ri6 |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.301 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((phenix.refine: 1.8.4_1496)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 59.950 | 1.900 |
| High resolution limit [Å] | 1.798 | 1.798 |
| Rmerge | 0.124 | 0.614 |
| Number of reflections | 36838 | |
| <I/σ(I)> | 11.7 | 2.1 |
| Completeness [%] | 96.5 | 79 |
| Redundancy | 6.6 | 4.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH UNDER OIL | 6.5 | 277 | 30% w/v PEG4000, 100 mM MES sodium, pH 6.5, MICROBATCH UNDER OIL, temperature 277K |
